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List of all members | Public Attributes
gmx::test::anonymous_namespace{bonded.cpp}::OutputQuantities Struct Reference


Output from bonded kernels.

Later this might turn into the actual output struct.

Public Attributes

real energy = 0
 Energy of this interaction.
real dvdlambda = 0
 Derivative with respect to lambda.
rvec fshift [c_numShiftVectors] = { { 0 } }
 Shift vectors.
rvec4 f [c_numAtoms] = { { 0 } }

The documentation for this struct was generated from the following file: